N-[2-(isopropylamino)ethyl]-p-toluenesulfonamide

HCID 21568614

Completing data — usually done within a minute

Basic information

CAS
58677-42-2
Standard SMILES
Cc1ccc(S(=O)(=O)NCCNC(C)C)cc1
InChIKey
XUYSMCFRSWTUQI-UHFFFAOYSA-N
Molecular formula
C12H20N2O2S
Average molar mass
256.37 g/mol
Monoisotopic mass
256.12454888

Names & identifiers

Preferred name
N-[2-(isopropylamino)ethyl]-p-toluenesulfonamide
IUPAC
4-methyl-N-[2-(propan-2-ylamino)ethyl]benzenesulfonamide

Names & synonyms

N-[2-(isopropylamino)ethyl]-p-toluenesulfonamideSCHEMBL11772383XUYSMCFRSWTUQI-UHFFFAOYSA-NDTXSID901184727AKOS00611292058677-42-2N-[2-(isopropylamino) ethyl]-p-toluenesulfonamide4-Methyl-N-[2-[(1-methylethyl)amino]ethyl]benzenesulfonamide4-Methyl-N-{2-[(propan-2-yl)amino]ethyl}benzene-1-sulfonamide

Database identifiers

CAS
58677-42-2
PubChem CID
21568614
DTXSID
DTXSID901184727

Properties

Computed structural propertiesFilling in

XLogP
1.6
Topological polar surface area
66.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
17

Related reactions

3 records

Compound notes

Loading…